6SV1
Crystal structure of Rhodospirillum rubrum Rru_A0973 E34A variant
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | DIAMOND BEAMLINE I03 |
| Synchrotron site | Diamond |
| Beamline | I03 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2015-05-10 |
| Detector | DECTRIS PILATUS 6M |
| Wavelength(s) | 1.74 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 97.794, 120.136, 139.335 |
| Unit cell angles | 90.00, 95.20, 90.00 |
Refinement procedure
| Resolution | 48.730 - 2.190 |
| R-factor | 0.173 |
| Rwork | 0.171 |
| R-free | 0.20730 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 5da5 |
| RMSD bond length | 0.012 |
| RMSD bond angle | 0.890 |
| Data reduction software | XDS |
| Data scaling software | Aimless |
| Phasing software | PHASER |
| Refinement software | PHENIX (1.13_2998) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 48.730 | 2.265 |
| High resolution limit [Å] | 2.186 | 2.186 |
| Rmerge | 0.094 | 0.688 |
| Rmeas | 0.116 | 0.842 |
| Rpim | 0.065 | 0.477 |
| Number of reflections | 314834 | 30221 |
| <I/σ(I)> | 8.04 | 1.43 |
| Completeness [%] | 96.4 | 92.66 |
| Redundancy | 2.9 | 2.9 |
| CC(1/2) | 0.995 | 0.579 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 8.5 | 298 | 15% (w/v) PEG 3350, 0.14 M Calcium Acetate |
